TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 439.491 | Formula: C20H21N7O3S
H donors: 2 H acceptors: 5 LogP: 1.03 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)n1nc(c2c1c1cn[nH]c1cc2)C(=O)N
InChi: 1S/C20H21N7O3S/c1-25-8-10-26(11-9-25)31(29,30)14-4-2-13(3-5-14)27-19-15(18(24-27)20(21)28)6-7-17-16(19)12-22-23-17/h2-7,12H,8-11H2,1H3,(H2,21,28)(H,22,23)
InChiKey: RUOIDLYFQJFGQQ-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	cyclin A1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania major	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Onchocerca volvulus		Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma brucei	mitotic cyclin 6	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania infantum	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Candida albicans	hypothetical protein	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Giardia lamblia	G2/mitotic-specific cyclin B	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma congolense	mitotic cyclin 6	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma cruzi	cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania donovani	CYC2-like cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania braziliensis	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma congolense	Cyclin, N-terminal domain/Cyclin, C-terminal domain containing protein, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania mexicana	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma brucei gambiense	cyclin 6,mitotic cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Echinococcus granulosus	cyclin B	Get druggable targets OG5_126649	All targets in OG5_126649
Candida albicans	likely G2 B-type cyclin similar to S. cerevisiae CLB1 (YPR119W) which is involved in mitotic induction	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Brugia malayi	Cyclin, N-terminal domain containing protein	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma cruzi	cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Schistosoma mansoni	cyclin B	Get druggable targets OG5_126649	All targets in OG5_126649
Schistosoma japonicum	ko:K05868 cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Entamoeba histolytica	cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania mexicana	CYC2-like cyclin, putative,cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Cryptosporidium hominis	mitotic cyclin-CYC2	Get druggable targets OG5_126649	All targets in OG5_126649
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma cruzi	CYC2-like cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Echinococcus multilocularis	cyclin B	Get druggable targets OG5_126649	All targets in OG5_126649
Candida albicans	likely G2 B-type cyclin similar to S. cerevisiae CLB1 (YPR119W) which is involved in mitotic induction	Get druggable targets OG5_126649	All targets in OG5_126649
Candida albicans	likely B-type cyclin similar to S. cerevisiae CLB4 (YLR210W) and CLB3 (YDL155W) involved in G1/S transition	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma cruzi	cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania braziliensis	CYC2-like cyclin, putative,cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Brugia malayi	Cyclin, N-terminal domain containing protein	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania donovani	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclin A, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Cryptosporidium parvum	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania infantum	CYC2-like cyclin, putative,cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0135	0.3202	0.3703
Trypanosoma cruzi	cyclin, putative	0.0051	0.1113	0.5
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0135	0.3202	0.3703
Onchocerca volvulus		0.0057	0.1249	0.0844
Brugia malayi	nuclear receptor NHR-88	0.0057	0.1249	0.1218
Brugia malayi	tailless protein	0.0057	0.1249	0.1218
Brugia malayi	Nuclear hormone receptor E75	0.0057	0.1249	0.1218
Echinococcus granulosus	cyclins	0.0021	0.036	0.0417
Loa Loa (eye worm)	hypothetical protein	0.0078	0.1775	0.1744
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0135	0.3202	0.3703
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0051	0.1113	0.1081
Brugia malayi	Nuclear hormone receptor-like 1	0.0078	0.1775	0.1746
Schistosoma mansoni	cpg binding protein	0.0025	0.0442	0.0511
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0135	0.3202	0.3176
Brugia malayi	Pre-SET motif family protein	0.0026	0.048	0.0446
Trypanosoma brucei	mitotic cyclin 6	0.0051	0.1113	0.5
Schistosoma mansoni	coup transcription factor	0.0135	0.3202	0.3703
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0057	0.1249	0.1444
Brugia malayi	hypothetical protein	0.0078	0.1775	0.1746
Loa Loa (eye worm)	hypothetical protein	0.0135	0.3202	0.3176
Brugia malayi	Nuclear hormone receptor-like 1	0.0078	0.1775	0.1746
Echinococcus multilocularis	cyclins	0.0021	0.036	0.0417
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0135	0.3202	0.3176
Schistosoma mansoni	thyroid hormone receptor	0.0135	0.3202	0.3703
Loa Loa (eye worm)	DR-78	0.0057	0.1249	0.1216
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0057	0.1249	0.1444
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0135	0.3202	0.3178
Loa Loa (eye worm)	steroid hormone receptor	0.0388	0.9551	0.9549
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0135	0.3202	0.3703
Echinococcus multilocularis	cyclins	0.0021	0.036	0.0417
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0251	0.6128	1
Brugia malayi	Steroid receptor seven-up type 2	0.0135	0.3202	0.3178
Loa Loa (eye worm)	cyclin domain-containing protein	0.0021	0.036	0.0324
Loa Loa (eye worm)	hypothetical protein	0.0078	0.1775	0.1744
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0135	0.3202	0.3703
Echinococcus granulosus	cyclin B3 1	0.0021	0.036	0.0417
Loa Loa (eye worm)	hypothetical protein	0.0135	0.3202	0.3176
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0135	0.3202	0.3178
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0135	0.3202	0.3178
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0078	0.1775	0.2053
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0135	0.3202	0.3176
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0135	0.3202	0.3703
Echinococcus multilocularis	cyclin B3 1	0.0021	0.036	0.0417
Trichomonas vaginalis	cyclins, putative	0.0051	0.1113	0.1305
Brugia malayi	hypothetical protein	0.0057	0.1249	0.1218
Entamoeba histolytica	cyclin, putative	0.0051	0.1113	0.1305
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0026	0.048	0.3159
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0135	0.3202	0.3176
Echinococcus granulosus	thyroid hormone receptor alpha	0.031	0.7598	0.8787
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0123	0.2903	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0135	0.3202	0.3176
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0057	0.1249	0.1444
Schistosoma mansoni	nuclear receptor	0.0057	0.1249	0.1444
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0057	0.1249	0.1444
Loa Loa (eye worm)	hypothetical protein	0.0135	0.3202	0.3176
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0057	0.1249	0.1216
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0025	0.0442	0.0406
Loa Loa (eye worm)	hypothetical protein	0.0026	0.048	0.0444
Echinococcus multilocularis	cyclins	0.0021	0.036	0.0417
Echinococcus granulosus	FTZ F1 alpha	0.0135	0.3202	0.3703
Echinococcus granulosus	cyclins	0.0021	0.036	0.0417
Echinococcus granulosus	nuclear receptor nhr 48	0.0057	0.1249	0.1444
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.0021	0.036	0.0417
Loa Loa (eye worm)	hypothetical protein	0.0135	0.3202	0.3176
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0179	0.4326	0.4304
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.0051	0.1113	0.5
Trichomonas vaginalis	cyclins, putative	0.0051	0.1113	0.1305
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0251	0.6128	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0135	0.3202	0.3178
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0135	0.3202	0.3178
Loa Loa (eye worm)	hypothetical protein	0.0135	0.3202	0.3176
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0025	0.0443	0.0512
Brugia malayi	nuclear hormone receptor	0.0135	0.3202	0.3178
Schistosoma mansoni	nuclear receptor nhr-48	0.0057	0.1249	0.1444
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0251	0.6128	1
Echinococcus multilocularis	cpg binding protein	0.0026	0.0477	0.0552
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0057	0.1249	0.1444
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0135	0.3202	0.3178
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Onchocerca volvulus		0.0204	0.4946	0.4713
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0078	0.1775	0.2053
Schistosoma mansoni	zinc finger protein	0.0057	0.1249	0.1444
Brugia malayi	Nuclear hormone receptor-like 1	0.0135	0.3202	0.3178
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0026	0.048	0.0555
Echinococcus granulosus	ecdysone induced protein 78C	0.0135	0.3202	0.3703
Brugia malayi	nuclear receptor NHR-67	0.0057	0.1249	0.1218
Onchocerca volvulus	Bile acid receptor homolog	0.0405	1	1
Schistosoma mansoni	cyclin B3	0.0021	0.036	0.0417
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0135	0.3202	0.3176
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0026	0.048	0.0555
Schistosoma mansoni	hypothetical protein	0.0352	0.8647	1
Trichomonas vaginalis	set domain proteins, putative	0.0204	0.4946	0.7951
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0135	0.3202	0.3703
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0123	0.2903	0.5
Brugia malayi	photoreceptor-specific nuclear receptor	0.0135	0.3202	0.3178
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0038	0.0044
Loa Loa (eye worm)	hypothetical protein	0.0051	0.1113	0.1079
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0251	0.6128	1
Schistosoma mansoni	cpg binding protein	0.0026	0.0477	0.0552
Brugia malayi	hypothetical protein	0.0078	0.1775	0.1746
Giardia lamblia	G2/mitotic-specific cyclin B	0.0051	0.1113	0.1305
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0251	0.6128	1
Brugia malayi	nuclear receptor RXR	0.0057	0.1249	0.1218
Schistosoma mansoni	nuclear hormone receptor	0.0057	0.1249	0.1444
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0135	0.3202	0.3178
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0135	0.3202	0.3703
Plasmodium vivax	SET domain protein, putative	0.0026	0.048	0.5
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0057	0.1249	0.1218
Trichomonas vaginalis	cyclin B, putative	0.0051	0.1113	0.1305
Brugia malayi	CXXC zinc finger family protein	0.0025	0.0442	0.0408
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0038	0.0044
Loa Loa (eye worm)	hypothetical protein	0.003	0.0575	0.0539
Treponema pallidum	fructose-bisphosphate aldolase	0.0251	0.6128	0.5
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0078	0.1775	0.2053
Echinococcus multilocularis	cyclins	0.0021	0.036	0.0417
Echinococcus multilocularis	nuclear receptor nhr 48	0.0057	0.1249	0.1444
Echinococcus granulosus	cyclin B	0.0051	0.1113	0.1287
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0135	0.3202	0.3176
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0135	0.3202	0.3703
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0057	0.1249	0.1216
Brugia malayi	Nuclear hormone receptor E75	0.0057	0.1249	0.1218
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0251	0.6128	1
Echinococcus granulosus	cyclins	0.0021	0.036	0.0417
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0135	0.3202	0.3703
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0057	0.1249	0.1444
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0057	0.1249	0.0844
Loa Loa (eye worm)	hypothetical protein	0.0405	1	1
Echinococcus granulosus	histone lysine methyltransferase setb	0.0026	0.048	0.0555
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0057	0.1249	0.1218
Onchocerca volvulus		0.0057	0.1249	0.0844
Trichomonas vaginalis	cyclin B, putative	0.0051	0.1113	0.1305
Echinococcus multilocularis	cyclins	0.0021	0.036	0.0417
Loa Loa (eye worm)	hypothetical protein	0.0135	0.3202	0.3176
Brugia malayi	nuclear receptor RXR	0.0078	0.1775	0.1746
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Trypanosoma cruzi	cyclin 6, putative	0.0051	0.1113	0.5
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0135	0.3202	0.3703
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0057	0.1249	0.0844
Echinococcus multilocularis	cyclins	0.0021	0.036	0.0417
Loa Loa (eye worm)	hypothetical protein	0.0051	0.1113	0.1079
Loa Loa (eye worm)	hypothetical protein	0.0078	0.1775	0.1744
Trichomonas vaginalis	cyclins, putative	0.0051	0.1113	0.1305
Schistosoma mansoni	thyroid hormone receptor	0.0135	0.3202	0.3703
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0135	0.3202	0.3178
Echinococcus multilocularis	cyclin b3	0.0021	0.036	0.0417
Onchocerca volvulus	Protein ultraspiracle homolog	0.0135	0.3202	0.2887
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0135	0.3202	0.3178
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0026	0.048	0.0555
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0135	0.3202	0.2887
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0135	0.3202	0.3178
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Brugia malayi	conserved hypotetical protein	0.0057	0.1249	0.1218
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0057	0.1249	0.1444
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0026	0.048	0.0555
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0057	0.1249	0.1444
Trypanosoma cruzi	CYC2-like cyclin, putative	0.0051	0.1113	0.5
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Echinococcus multilocularis	cyclins	0.0021	0.036	0.0417
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0135	0.3202	0.3703
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Brugia malayi	hypothetical protein	0.0057	0.1249	0.1218
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0057	0.1249	0.1444
Echinococcus multilocularis	FTZ F1 alpha	0.0135	0.3202	0.3703
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0135	0.3202	0.3178
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0135	0.3202	0.3178
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0135	0.3202	0.3703
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0135	0.3202	0.3178
Plasmodium falciparum	cyclin	0.0021	0.036	0.5
Loa Loa (eye worm)	nuclear hormone receptor	0.0057	0.1249	0.1216
Schistosoma mansoni	nuclear hormone receptor	0.0135	0.3202	0.3703
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0135	0.3202	0.3703
Brugia malayi	nuclear hormone receptor family member odr-7	0.0057	0.1249	0.1218
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0026	0.048	0.0555
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0251	0.6128	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0135	0.3202	0.3703
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0251	0.6128	1
Echinococcus multilocularis	dnaJ subfamily B	0.0352	0.8647	1
Schistosoma mansoni	cpg binding protein	0.0026	0.0477	0.0552
Echinococcus granulosus	cyclins	0.0021	0.036	0.0417
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0057	0.1249	0.1444
Schistosoma mansoni	cyclins	0.0021	0.036	0.0417
Trypanosoma cruzi	cyclin, putative	0.0051	0.1113	0.5
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0051	0.1113	0.1081
Echinococcus multilocularis	ecdysone induced protein 78C	0.0135	0.3202	0.3703
Schistosoma mansoni	nuclear receptor	0.0057	0.1249	0.1444
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Trichomonas vaginalis	cyclin B, putative	0.0051	0.1113	0.1305
Brugia malayi	steroid hormone receptor	0.0388	0.9551	0.9549
Brugia malayi	nuclear receptor NHR-88	0.0135	0.3202	0.3178
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0135	0.3202	0.3703
Loa Loa (eye worm)	hypothetical protein	0.0078	0.1775	0.1744
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0078	0.1775	0.2053
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0053	0.116	0.1342
Schistosoma mansoni	cyclin B	0.0051	0.1113	0.1287
Echinococcus multilocularis	cyclin B	0.0051	0.1113	0.1287
Leishmania major	cyclin	0.0051	0.1113	0.5
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0251	0.6128	1
Trichomonas vaginalis	cyclins, putative	0.0051	0.1113	0.1305
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0135	0.3202	0.3703
Brugia malayi	nuclear hormone receptor	0.0057	0.1249	0.1218
Trichomonas vaginalis	cyclins, putative	0.0035	0.0705	0.0597
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0021	0.036	0.0326
Echinococcus granulosus	dnaJ subfamily B	0.0352	0.8647	1
Onchocerca volvulus		0.0135	0.3202	0.2887
Loa Loa (eye worm)	hypothetical protein	0.0135	0.3202	0.3176
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0135	0.3202	0.3703
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0026	0.048	0.0555
Echinococcus granulosus	cyclin b3	0.0021	0.036	0.0417
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0135	0.3202	0.3703
Schistosoma mansoni	nuclear hormone receptor	0.0057	0.1249	0.1444
Giardia lamblia	Fructose-bisphosphate aldolase	0.0251	0.6128	1
Trichomonas vaginalis	cyclin A, putative	0.0051	0.1113	0.1305
Onchocerca volvulus		0.0026	0.048	0.004
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0135	0.3202	0.3703
Brugia malayi	orphan nuclear receptor NR2E1	0.0057	0.1249	0.1218
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0078	0.1775	0.1744
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.0021	0.036	0.0417
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0251	0.6128	1
Schistosoma mansoni	RAR-like nuclear receptor	0.0135	0.3202	0.3703
Echinococcus granulosus	cyclins	0.0021	0.036	0.0417
Brugia malayi	Pre-SET motif family protein	0.0179	0.4326	0.4306
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Schistosoma mansoni	retinoic acid receptor RXR	0.0135	0.3202	0.3703
Echinococcus granulosus	cpg binding protein	0.0026	0.0477	0.0552
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0135	0.3202	0.3703
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0048	0.102	1
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0057	0.1249	0.1444
Brugia malayi	ecdysone receptor	0.0057	0.1249	0.1218
Trichomonas vaginalis	cyclin B, putative	0.0051	0.1113	0.1305
Onchocerca volvulus		0.0051	0.1113	0.0702
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1249	0.1216
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0123	0.2903	0.5
Loa Loa (eye worm)	hypothetical protein	0.0078	0.1775	0.1744

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.15 uM	Inhibition of Cyclin A-cyclin-dependent kinase 2	ChEMBL.	15713378
IC50 (binding)	= 0.15 uM	Inhibition of Cyclin A-cyclin-dependent kinase 2	ChEMBL.	15713378
IC50 (functional)	> 20 uM	Inhibition of A2780 ovarian tumor cell proliferation	ChEMBL.	15713378
IC50 (functional)	> 20 uM	Inhibition of A2780 ovarian tumor cell proliferation	ChEMBL.	15713378

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 314817